Molecule ID: mol34458

SMILES: CC(C)CCC1(Br)C(=O)NC(=O)NC1=O

InChI: InChI=1S/C9H13BrN2O3/c1-5(2)3-4-9(10)6(13)11-8(15)12-7(9)14/h5H,3-4H2,1-2H3,(H2,11,12,13,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.53 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization